SCHEMBL8337837

SCHEMBL8337837

C/C(=C/c1ccc(-c2ccccc2)o1)SC(=S)N(C)C=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.43
▸ LMNA P02545 8/20 0.43
▸ MEN1 O00255 8/20 0.43
▸ KMT2A Q03164 8/20 0.43
▸ ALDH1A1 P00352 8/20 0.43
▸ TP53 P04637 2/20 0.41
▸ HPGD P15428 6/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ PKM P14618 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ GFER P55789 1/20 0.40
▸ ALOX5 P09917 1/20 0.39
▸ KDM4E B2RXH2 5/20 0.39
▸ ALOX12 P18054 1/20 0.38
▸ POLB P06746 4/20 0.38
▸ HTT P42858 2/20 0.38
▸ RECQL P46063 1/20 0.38
▸ TDP1 Q9NUW8 2/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14667461 0.68 MAPT (0.55) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL13766486 0.67 MAPT (0.44) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL622653 0.65 KDM4E (0.66) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL2554804 0.65 MAPT (0.58) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL2554802 0.65 MAPT (0.58) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL23731503 0.63 TDP1 (0.57) MAPTMEN1KMT2AALDH1A1TP53
SCHEMBL8806045 0.63 ALDH1A1 (0.57) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL4459311 0.62 MAPT (0.59) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL12279902 0.62 MAPT (0.71) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL25151642 0.62 MAPT (0.43) MAPTLMNAMEN1KMT2AALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004043955-A1 RHODANINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RIGEL PHARMACEUTICALS, INC. (US) 2004-05-27 — — WO disclosed
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